Methyl 2-bromo-2- (2-bromophenyl) acetate

CAT: 0926-TBA06397-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-TBA06397-01Size:100 mg

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CAS Number

43063-97-4

MDL Number

MFCD30344899

Smiles

COC (=O) C (C1=CC=CC=C1Br) Br

Molecular Formula

C9H8Br2O2

Molecular Weight

307.97 g/mol

Controlled

Chemical Information

Methyl 2-bromo-2-(2-bromophenyl)acetate

CAS Number	43063-97-4
PubChem CID	19385733
IUPAC Name	methyl 2-bromo-2-(2-bromophenyl)acetate
Molecular Formula	C9H8Br2O2
Molecular Weight	307.97
XLogP	3.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	184

SMILES

COC(=O)C(C1=CC=CC=C1Br)Br

InChI

InChI=1S/C9H8Br2O2/c1-13-9(12)8(11)6-4-2-3-5-7(6)10/h2-5,8H,1H3

InChIKey

VZMMSUIICCIPQY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 43063-97-4

CID: 19385733

Formula: C9H8Br2O2

MW: 307.97

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	307.97
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	307.88706
Monoisotopic Mass	305.88910
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	184
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
NGA33967-01	Methyl 2-bromo-2- (3-bromophenyl) acetate
FM46201	Methyl 2- (3-bromophenyl) acetate
LAC76284-01	Methyl 2- (2-amino-3-bromophenyl) acetate
WFC96745-01	Methyl 2- (3-bromophenyl) -2- (diethoxyphosphoryl) acetate
UYB40844-01	Methyl amino (2-bromophenyl) acetate hydrochloride
QJB70752-01	Methyl 2-[ (3-bromophenyl) sulfanyl]acetate
CDA82552-01	Methyl 2-bromo-2- (methylsulfanyl) acetate
CDA05354-01	Methyl 2-bromo-2- (2-methylphenyl) acetate
KFA66093-01	Methyl 2-bromo-2- (2-fluorophenyl) acetate
XWC66824-01	Methyl 2-{[ (3-bromophenyl) methyl]amino}acetate hydrochloride

Catalog	Name
454713-01	Methyl 2- (2-Bromophenyl) acetate
448870-01	Ethyl 2-bromo-2- (4-bromophenyl) acetate
283727-01	Methyl 2- (3-bromophenyl) acetate
FH KK 0008-01	[acetyloxy- (2-bromophenyl) methyl] acetate
sc-358288	Methyl 2- (2- (benzyloxy) -5-bromophenyl) acetate
sc-234923	Ethyl 2-bromo- (4-bromophenyl) acetate
OR1053927	Methyl 2-bromo-2- (2-methoxyphenyl) acetate
OR85759-01	Methyl 2-bromo-2- (2-nitrophenyl) acetate
M3393-74	Methyl 2- (4-Bromophenyl) -2,2-di- (methyl-d3) acetate
MBS6065526-01	Methyl 2-(4-Bromophenyl)-2,2-di-(methyl-d3)acetate